(4E)-4-[[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: (4E)-4-[[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: (4E)-4-[[3-nitro-4-(p-tolylsulfanyl)phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: (4E)-4-[[4-[(4-methylphenyl)thio]-3-nitrophenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: (4E)-4-[[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: (4E)-4-[3-nitro-4-(p-tolylthio)benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C23H17N3O4S MolecularWeight: 431.46378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)/C=C/3\C(=O)NN(C3=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H17N3O4S/c1-15-7-10-18(11-8-15)31-21-12-9-16(14-20(21)26(29)30)13-19-22(27)24-25(23(19)28)17-5-3-2-4-6-17/h2-14H,1H3,(H,24,27)/b19-13+